Information card for entry 7035009

Structure parameters

• Formula: C41 H22 Cu F26 N2 O P3
• Calculated formula: C41 H22 Cu F26 N2 O P3
• SMILES: [Cu]12([P](c3c(F)c(F)c(F)c(F)c3F)(CC[P]1(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F)[n]1c(cc(cc1)C)c1cc(cc[n]21)C.[P](F)(F)(F)(F)(F)[F-].O=C(C)C
• Title of publication: Long-lived and oxygen-responsive photoluminescence in the solid state of copper(i) complexes bearing fluorinated diphosphine and bipyridine ligands.
• Authors of publication: Nishikawa, Michihiro; Wakita, Yuri; Nishi, Tatsuya; Miura, Takumi; Tsubomura, Taro
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 19
• Pages of publication: 9170 - 9181
• a: 20.0258 ± 0.0009 Å
• b: 20.3253 ± 0.0009 Å
• c: 23.228 ± 0.0011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9454.5 ± 0.7 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 61
• Hermann-Mauguin space group symbol: P c a b
• Hall space group symbol: -P 2bc 2ac
• Residual factor for all reflections: 0.0827
• Residual factor for significantly intense reflections: 0.0777
• Weighted residual factors for all reflections included in the refinement: 0.1461
• Goodness-of-fit parameter for all reflections included in the refinement: 1.352
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No